Water → 5-Amino-1-(3-chloro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-thioacetylpyrazole
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][n:6][n:7](-[c:10]2[n:11][n:12]3[c:13]([c:18]2[Cl:19])[CH2:14][CH2:15][CH2:16][CH2:17]3)[c:8]1[NH2:9].[CH2:43]([CH2:44][O:45][CH3:46])[O:47][CH3:48].[CH3:20][O:21][c:22]1[cH:23][cH:24][c:25]([P:26]2(=[S:29])[S:27][P:28]([c:30]3[cH:31][cH:32][c:33]([O:34][CH3:35])[cH:36][cH:37]3)(=[S:38])[S:39]2)[cH:40][cH:41]1.[OH2:42]>>[C:1]([CH3:2])([c:4]1[cH:5][n:6][n:7](-[c:10]2[n:11][n:12]3[c:13]([c:18]2[Cl:19])[CH2:14][CH2:15][CH2:16][CH2:17]3)[c:8]1[NH2:9])=[S:29]Participants
5
Sources & evidence
- ORD record
- ord-cf3b57eede504aeaa9a78c2574dba390
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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